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Crystal Structure of FVO strain Plasmodium falciparum AMA1
Descriptor:	Apical membrane antigen 1
Authors:	Lim, S.S, Norton, R.S, McGowan, S.
Deposit date:	2014-08-04
Release date:	2015-01-14
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (2 Å)
Cite:	Structure and Dynamics of Apical Membrane Antigen 1 from Plasmodium falciparum FVO. Biochemistry, 53, 2014

4R19

Crystal Structure of 3D7 strain Plasmodium falciparum AMA1
Descriptor:	Apical membrane antigen 1, AMA1
Authors:	Lim, S.S, Norton, R.S, McGowan, S.
Deposit date:	2014-08-04
Release date:	2015-01-14
Last modified:	2024-10-09
Method:	X-RAY DIFFRACTION (1.8 Å)
Cite:	Structure and Dynamics of Apical Membrane Antigen 1 from Plasmodium falciparum FVO. Biochemistry, 53, 2014

7TTV

E.coli DsbA in complex with 4-phenyl-2-(3-phenylpropyl)thiazole-5-carboxylic acid
Descriptor:	4-phenyl-2-(3-phenylpropyl)-1,3-thiazole-5-carboxylic acid, COPPER (II) ION, Thiol:disulfide interchange protein DsbA
Authors:	Wang, G, Heras, B.
Deposit date:	2022-02-02
Release date:	2023-04-12
Last modified:	2023-10-25
Method:	X-RAY DIFFRACTION (1.99 Å)
Cite:	Methyl probes in proteins for determining ligand binding mode in weak protein-ligand complexes. Sci Rep, 12, 2022

6DNV

Crystal Structure of Neisseria meningitidis DsbD n-terminal domain in the reduced form
Descriptor:	SULFATE ION, Thiol:disulfide interchange protein DsbD
Authors:	Smith, R.P, Heras, B, Paxman, J.J.
Deposit date:	2018-06-08
Release date:	2018-09-12
Last modified:	2024-03-13
Method:	X-RAY DIFFRACTION (1.603 Å)
Cite:	Structural and biochemical insights into the disulfide reductase mechanism of DsbD, an essential enzyme for neisserial pathogens. J. Biol. Chem., 293, 2018

6DPS

Crystal Structure of Neisseria meningitidis DsbD n-terminal domain in the oxidised form
Descriptor:	Thiol:disulfide interchange protein DsbD, ZINC ION
Authors:	Heras, B, Smith, R.P, Paxman, J.J.
Deposit date:	2018-06-09
Release date:	2018-09-12
Last modified:	2018-11-07
Method:	X-RAY DIFFRACTION (2.556 Å)
Cite:	Structural and biochemical insights into the disulfide reductase mechanism of DsbD, an essential enzyme for neisserial pathogens. J. Biol. Chem., 293, 2018

6DNU

Crystal Structure of Neisseria meningitidis DsbD c-terminal domain in the oxidised form
Descriptor:	HEXAETHYLENE GLYCOL, Thiol:disulfide interchange protein DsbD
Authors:	Heras, B, Smith, R.P, Paxman, J.J.
Deposit date:	2018-06-07
Release date:	2018-09-12
Last modified:	2018-11-07
Method:	X-RAY DIFFRACTION (2.283 Å)
Cite:	Structural and biochemical insights into the disulfide reductase mechanism of DsbD, an essential enzyme for neisserial pathogens. J. Biol. Chem., 293, 2018

6DNL

Crystal Structure of Neisseria meningitidis DsbD c-terminal domain in the reduced form
Descriptor:	ACETATE ION, Thiol:disulfide interchange protein DsbD, ZINC ION
Authors:	Smith, R.P, Heras, B, Paxman, J.J.
Deposit date:	2018-06-06
Release date:	2018-09-12
Last modified:	2024-03-13
Method:	X-RAY DIFFRACTION (1.7 Å)
Cite:	Structural and biochemical insights into the disulfide reductase mechanism of DsbD, an essential enzyme for neisserial pathogens. J. Biol. Chem., 293, 2018

8D12

Crystal Structure of EcDsbA in a complex with 1-methyl-1H-pyrazol-4-amine
Descriptor:	1-methyl-1H-pyrazol-4-amine, COPPER (II) ION, Thiol:disulfide interchange protein DsbA
Authors:	Whitehouse, R.L, Ilyichova, O.V, Taylor, A.J.
Deposit date:	2022-05-26
Release date:	2022-12-07
Last modified:	2023-10-25
Method:	X-RAY DIFFRACTION (1.6 Å)
Cite:	Fragment screening libraries for the identification of protein hot spots and their minimal binding pharmacophores. Rsc Med Chem, 14, 2023

8CZM

Crystal Structure of EcDsbA in a complex with 4-bromo-1H-pyrazole
Descriptor:	4-bromo-1H-pyrazole, TRIETHYLENE GLYCOL, Thiol:disulfide interchange protein DsbA
Authors:	Whitehouse, R.L, Ilyichova, O.V, Taylor, A.J.
Deposit date:	2022-05-25
Release date:	2022-12-07
Last modified:	2023-10-25
Method:	X-RAY DIFFRACTION (1.8 Å)
Cite:	Fragment screening libraries for the identification of protein hot spots and their minimal binding pharmacophores. Rsc Med Chem, 14, 2023

8CXD

Crystal Structure of EcDsbA in a complex with phenylmethanol
Descriptor:	COPPER (II) ION, Thiol:disulfide interchange protein DsbA, phenylmethanol
Authors:	Whitehouse, R.L, Ilyichova, O.V, Taylor, A.J.
Deposit date:	2022-05-20
Release date:	2022-12-07
Last modified:	2024-10-16
Method:	X-RAY DIFFRACTION (1.8 Å)
Cite:	Fragment screening libraries for the identification of protein hot spots and their minimal binding pharmacophores. Rsc Med Chem, 14, 2023

8CZN

Crystal Structure of EcDsbA in a complex with 1H-pyrrole-3-carboxylic acid
Descriptor:	1H-pyrrole-3-carboxylic acid, COPPER (II) ION, Thiol:disulfide interchange protein DsbA
Authors:	Whitehouse, R.L, Ilyichova, O.V, Taylor, A.J.
Deposit date:	2022-05-25
Release date:	2022-12-07
Last modified:	2024-10-16
Method:	X-RAY DIFFRACTION (1.7 Å)
Cite:	Fragment screening libraries for the identification of protein hot spots and their minimal binding pharmacophores. Rsc Med Chem, 14, 2023

8DG0

Crystal Structure of EcDsbA in a complex with Urea
Descriptor:	COPPER (II) ION, Thiol:disulfide interchange protein DsbA, UREA
Authors:	Whitehouse, R.L, Ilyichova, O.V, Taylor, A.J.
Deposit date:	2022-06-23
Release date:	2022-12-07
Last modified:	2023-10-25
Method:	X-RAY DIFFRACTION (2.5 Å)
Cite:	Fragment screening libraries for the identification of protein hot spots and their minimal binding pharmacophores. Rsc Med Chem, 14, 2023

8DG1

Crystal Structure of EcDsbA in a complex with DMSO
Descriptor:	COPPER (II) ION, DIMETHYL SULFOXIDE, Thiol:disulfide interchange protein DsbA
Authors:	Whitehouse, R.L, Ilyichova, O.V, Taylor, A.J.
Deposit date:	2022-06-23
Release date:	2022-12-07
Last modified:	2023-10-25
Method:	X-RAY DIFFRACTION (1.95 Å)
Cite:	Fragment screening libraries for the identification of protein hot spots and their minimal binding pharmacophores. Rsc Med Chem, 14, 2023

8CXE

Crystal Structure of EcDsbA in a complex with 1H-imidazole
Descriptor:	IMIDAZOLE, Thiol:disulfide interchange protein DsbA
Authors:	Whitehouse, R.L, Ilyichova, O.V, Taylor, A.J.
Deposit date:	2022-05-20
Release date:	2022-12-07
Last modified:	2024-10-30
Method:	X-RAY DIFFRACTION (1.47 Å)
Cite:	Fragment screening libraries for the identification of protein hot spots and their minimal binding pharmacophores. Rsc Med Chem, 14, 2023

8D10

Crystal Structure of EcDsbA in a complex with (1-methyl-1H-pyrazol-5-yl)methanamine
Descriptor:	1-(1-methyl-1H-pyrazol-5-yl)methanamine, COPPER (II) ION, Thiol:disulfide interchange protein DsbA
Authors:	Whitehouse, R.L, Ilyichova, O.V, Taylor, A.J.
Deposit date:	2022-05-26
Release date:	2022-12-07
Last modified:	2023-10-25
Method:	X-RAY DIFFRACTION (1.6 Å)
Cite:	Fragment screening libraries for the identification of protein hot spots and their minimal binding pharmacophores. Rsc Med Chem, 14, 2023

8DG2

Crystal Structure of EcDsbA in a complex with DMSO
Descriptor:	COPPER (II) ION, DIMETHYL SULFOXIDE, GLYCEROL, ...
Authors:	Whitehouse, R.L, Ilyichova, O.V, Taylor, A.J.
Deposit date:	2022-06-23
Release date:	2022-12-07
Last modified:	2023-10-25
Method:	X-RAY DIFFRACTION (1.95 Å)
Cite:	Fragment screening libraries for the identification of protein hot spots and their minimal binding pharmacophores. Rsc Med Chem, 14, 2023

8D11

Crystal Structure of EcDsbA in a complex with 1-methyl-1H-pyrazol-5-amine
Descriptor:	1-methyl-1H-pyrazol-5-amine, COPPER (II) ION, Thiol:disulfide interchange protein DsbA
Authors:	Whitehouse, R.L, Ilyichova, O.V, Taylor, A.J.
Deposit date:	2022-05-26
Release date:	2022-12-07
Last modified:	2023-10-25
Method:	X-RAY DIFFRACTION (1.85 Å)
Cite:	Fragment screening libraries for the identification of protein hot spots and their minimal binding pharmacophores. Rsc Med Chem, 14, 2023

6N7Q

Plasmodium falciparum FVO apical membrane antigen 1 (AMA1) bound to cyclised RON2 peptide
Descriptor:	Apical membrane antigen-1, RON2 peptide
Authors:	McGowan, S, Drinkwater, N.
Deposit date:	2018-11-28
Release date:	2019-01-30
Last modified:	2024-10-23
Method:	X-RAY DIFFRACTION (2.1 Å)
Cite:	Identification of the Binding Site of Apical Membrane Antigen 1 (AMA1) Inhibitors Using a Paramagnetic Probe. ChemMedChem, 14, 2019

4Y1C

Cyclic hexapeptide cyc[NdPopPKID] in complex with HIV-1 integrase core domain
Descriptor:	CADMIUM ION, Cyclic hexapeptide cyc[NdPopPKID], Integrase, ...
Authors:	Wielens, J, Chalmers, D.K.
Deposit date:	2015-02-07
Release date:	2015-02-25
Last modified:	2023-09-27
Method:	X-RAY DIFFRACTION (2.3 Å)
Cite:	HEXAPEPTIDE MIMETICS OF LEDGF IN COMPLEX WITH HIV-1 INTEGRASE To Be Published

6N87

Plasmodium falciparum FVO apical membrane antigen 1 (AMA1) bound to MTSL spin-labelled cyclised RON2 peptide
Descriptor:	Apical membrane antigen-1, S-[(1-oxyl-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrol-3-yl)methyl] methanesulfonothioate, backbone-cyclised peptide bcRON2hp
Authors:	McGowan, S, Drinkwater, N.
Deposit date:	2018-11-28
Release date:	2019-01-30
Last modified:	2024-10-23
Method:	X-RAY DIFFRACTION (1.588 Å)
Cite:	Identification of the Binding Site of Apical Membrane Antigen 1 (AMA1) Inhibitors Using a Paramagnetic Probe. ChemMedChem, 14, 2019

4R1B

Crystal Structure of 3D7 strain Plasmodium falciparum AMA1
Descriptor:	Apical membrane antigen 1, AMA1
Authors:	Lim, S.S, Norton, R.S, McGowan, S.
Deposit date:	2014-08-04
Release date:	2015-01-14
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (1.6 Å)
Cite:	Structure and Dynamics of Apical Membrane Antigen 1 from Plasmodium falciparum FVO. Biochemistry, 53, 2014

2MIM

NMR structure of the chicken CD3 epsilon delta/gamma heterodimer
Descriptor:	CD3 epsilon protein,CD3 glycoprotein
Authors:	Headey, S, Berry, R, Rossjohn, J.
Deposit date:	2013-12-15
Release date:	2014-02-12
Last modified:	2019-01-23
Method:	SOLUTION NMR
Cite:	Structure of the chicken CD3 epsilon delta / gamma heterodimer and its assembly with the alpha beta T cell receptor J.Biol.Chem., 289, 2014

2MHC

NMR structure of the catalytic domain of the large serine resolvase TnpX
Descriptor:	TnpX
Authors:	Headey, S.J, Sivakumaran, A, Adams, V, Rodgers, A.J.W, Rood, J.I, Scanlon, M.J, Wilce, M.C.J.
Deposit date:	2013-11-20
Release date:	2014-11-26
Last modified:	2024-05-15
Method:	SOLUTION NMR
Cite:	Solution Structure and DNA Binding of the Catalytic of the Large Serine Resolvase Tnpx To be Published

1PT4

Solution structure of the Moebius cyclotide kalata B2
Descriptor:	kalata B2
Authors:	Jennings, C.V, Anderson, M.A, Daly, N.L, Rosengren, K.J, Craik, D.J.
Deposit date:	2003-06-23
Release date:	2004-08-10
Last modified:	2024-10-30
Method:	SOLUTION NMR
Cite:	Isolation, Solution Structure, and Insecticidal Activity of Kalata B2, a Circular Protein with a Twist: Do Mobius Strips Exist in Nature?(,) Biochemistry, 44, 2005

4Y1D

Cyclic hexapeptide cyc[NdPopPKID] in complex with HIV-1 integrase core domain
Descriptor:	CADMIUM ION, CHLORIDE ION, Cyclic hexapeptide cyc[NdPopPKID], ...
Authors:	Wielens, J, Chalmers, D.K.
Deposit date:	2015-02-07
Release date:	2015-05-13
Last modified:	2023-11-15
Method:	X-RAY DIFFRACTION (1.93 Å)
Cite:	HEXAPEPTIDE MIMETICS OF LEDGF IN COMPLEX WITH HIV-1 INTEGRASE To Be Published

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Displayed results:	25
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